SCHEMBL14441145

SCHEMBL14441145

COc1ccc(Cn2cnc3c(CI)ncnc32)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.60
SLC29A1 Q99808 2/20 0.55
HDAC1 Q13547 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
NSD3 Q9BZ95 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
NR3C1 P04150 2/20 0.45
DAPK1 P53355 1/20 0.45
ADORA2A P29274 2/20 0.45
PI4KA P42356 1/20 0.45
PI4K2B Q8TCG2 1/20 0.45
PI4K2A Q9BTU6 1/20 0.45
PI4KB Q9UBF8 1/20 0.45
FGFR1 P11362 1/20 0.45
FGFR2 P21802 1/20 0.45
FGFR4 P22455 1/20 0.45
FGFR3 P22607 1/20 0.45
MET P08581 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5465357 0.83 HPGD (0.64) HPGDSLC29A1HDAC1HDAC6NSD3
SCHEMBL1422156 0.82 NSD3 (0.70) HPGDSLC29A1HDAC1HDAC6NSD3
SCHEMBL3642511 0.82 HPGD (0.62) HPGDSLC29A1HDAC1HDAC6NSD3
SCHEMBL20774516 0.75 HPGD (0.54) HPGDSLC29A1HDAC1HDAC6MEN1
SCHEMBL30552245 0.75 HPGD (0.54) HPGDSLC29A1HDAC1HDAC6MEN1
SCHEMBL5452399 0.74 ADORA2A (0.72) HPGDSLC29A1HDAC1HDAC6ADORA2A
SCHEMBL1313539 0.73 HPGD (0.53) HPGDSLC29A1HDAC1HDAC6NSD3
SCHEMBL28950091 0.73 HPGD (0.64) HPGDSLC29A1HDAC1HDAC6MEN1
SCHEMBL6950422 0.73 HPGD (0.52) HPGDSLC29A1HDAC1HDAC6MEN1
SCHEMBL5471657 0.73 HSP90AA1 (0.54) HPGDHDAC1HDAC6MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070203159-A1 Purine compounds UNIVERSITETET I OLSO (NO) 2007-08-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070203159-A1 Purine compounds PNP, UMPS, TYMP HPGD 2203/4885SLC29A1 17/4885HDAC1 4234/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.